(3-nitrophenyl)-[4-(phenylmethyl)piperidin-1-yl]methanethione

Systemtic Name: (3-nitrophenyl)-[4-(phenylmethyl)piperidin-1-yl]methanethione Openeye Name: (4-benzyl-1-piperidyl)-(3-nitrophenyl)methanethione CAS Name: (3-nitrophenyl)-[4-(phenylmethyl)-1-piperidinyl]methanethione IUPAC Name: (4-benzylpiperidin-1-yl)-(3-nitrophenyl)methanethione Traditional Name: (4-benzylpiperidino)-(3-nitrophenyl)methanethione Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=S)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=S)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O2S/c22-21(23)18-8-4-7-17(14-18)19(24)20-11-9-16(10-12-20)13-15-5-2-1-3-6-15/h1-8,14,16H,9-13H2